#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1qez s LEU 3003N 0.00 2.24 0.38 -5.58 1.43 -1.26 -5.16 118.68 110.73 1qez s LEU 3003Ca 0.00 -0.57 0.06 0.00 -1.03 0.00 0.00 54.13 52.59 1qez s LEU 3003Cb 0.00 -0.67 -0.07 0.00 0.03 0.00 0.00 46.19 45.48 1qez s LEU 3003CO 0.00 0.01 0.02 -0.94 0.23 0.00 0.00 176.35 175.68 1qez s SER 3004N -1.52 3.38 0.44 2.29 1.04 -1.26 -4.46 113.70 113.61 1qez s SER 3004Ca 0.02 -1.37 0.29 0.00 0.48 0.00 0.00 55.95 55.37 1qez s SER 3004Cb -0.09 -0.30 1.00 0.00 0.10 0.00 0.00 66.02 66.74 1qez s SER 3004CO 0.02 -0.50 1.83 -0.65 0.98 0.00 0.00 173.24 174.93 1qez h PRO 3005N 1.89 0.00 0.00 4.02 0.11 -1.81 -3.42 132.00 132.79 1qez h PRO 3005Ca -0.43 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1qez h PRO 3005Cb 1.24 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.35 1qez h PRO 3005CO 0.77 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 178.97 1qez n GLY 3006N 0.40 3.63 0.30 -0.55 0.00 -1.26 -0.22 105.19 107.49 1qez n GLY 3006Ca 0.02 -1.53 0.18 0.00 0.00 0.00 0.00 46.02 44.69 1qez n GLY 3006CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1qez h LYS 3007N 0.00 0.00 -0.35 1.61 1.57 -1.94 -2.72 116.57 114.73 1qez h LYS 3007Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1qez h LYS 3007Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 1qez h LYS 3007CO 0.00 0.03 0.00 0.09 -0.57 0.00 0.00 179.45 179.00 1qez n ASN 3008N -3.29 4.16 -4.76 0.86 4.13 -1.26 -5.01 115.26 110.09 1qez n ASN 3008Ca -0.02 -2.84 -0.39 0.00 1.68 0.00 0.00 54.58 53.01 1qez n ASN 3008Cb 0.18 -0.53 0.03 0.00 -1.54 0.00 0.00 39.78 37.91 1qez n ASN 3008CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1qez s ALA 3009N -2.52 3.03 -2.28 5.41 0.00 -1.03 -1.23 121.76 123.14 1qez s ALA 3009Ca 0.43 1.42 0.20 0.00 0.00 0.00 0.00 51.96 54.01 1qez s ALA 3009Cb 0.33 -3.59 0.55 0.00 0.00 0.00 0.00 23.12 20.41 1qez s ALA 3009CO 0.12 -1.31 1.45 -0.35 0.00 0.00 0.00 175.76 175.67 1qez n PRO 3010N -0.62 2.13 -0.00 0.00 -0.04 -1.26 -4.87 135.00 130.34 1qez n PRO 3010Ca 0.08 -1.72 -0.02 0.00 -0.04 0.00 0.00 63.50 61.80 1qez n PRO 3010Cb 0.43 -1.44 0.24 0.00 -0.04 0.00 0.00 33.50 32.70 1qez n PRO 3010CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1qez h ASP 3011N 3.22 0.51 -3.23 3.54 3.32 -1.55 -3.42 116.42 118.80 1qez h ASP 3011Ca 0.00 -0.13 -0.24 0.00 0.02 0.00 0.00 57.03 56.68 1qez h ASP 3011Cb 0.72 -0.13 -0.32 0.00 0.22 0.00 0.00 39.33 39.81 1qez h ASP 3011CO 0.00 0.65 -0.57 -0.69 -1.72 0.00 0.00 179.24 176.92 1qez s VAL 3012N -4.76 -0.16 0.16 -1.35 1.01 -1.00 -4.30 120.40 110.00 1qez s VAL 3012Ca -0.07 0.23 0.06 0.00 0.00 0.00 0.00 61.98 62.20 1qez s VAL 3012Cb 0.15 -0.32 -0.04 0.00 0.00 0.00 0.00 36.38 36.16 1qez s VAL 3012CO 0.78 0.10 -0.12 0.68 0.00 0.00 0.00 175.10 176.53 1qez s VAL 3013N 1.67 1.40 0.07 2.92 -7.23 -0.58 -2.73 120.40 115.93 1qez s VAL 3013Ca -0.05 -2.05 -0.25 0.00 -1.81 0.00 0.00 61.98 57.83 1qez s VAL 3013Cb -0.11 -1.86 -0.06 0.00 0.56 0.00 0.00 36.38 34.91 1qez s VAL 3013CO -0.07 -0.63 0.76 0.20 -0.31 0.00 0.00 175.10 175.04 1qez s ASN 3014N -3.09 7.24 -0.11 4.85 0.01 0.70 -1.03 114.94 123.51 1qez s ASN 3014Ca 0.17 1.48 0.01 0.00 -0.71 0.00 0.00 52.86 53.81 1qez s ASN 3014Cb 0.00 -2.47 0.02 0.00 0.41 0.00 0.00 41.25 39.21 1qez s ASN 3014CO 0.03 0.08 -0.12 -0.69 -1.51 0.00 0.00 177.10 174.89 1qez s VAL 3015N -0.37 1.32 -0.39 1.60 1.01 -0.11 -4.08 120.40 119.38 1qez s VAL 3015Ca 0.37 -0.51 -0.21 0.00 0.00 0.00 0.00 61.98 61.64 1qez s VAL 3015Cb -0.21 -1.25 0.01 0.00 0.00 0.00 0.00 36.38 34.93 1qez s VAL 3015CO 0.23 0.41 0.66 -0.22 0.00 0.00 0.00 175.10 176.18 1qez s LEU 3016N 1.27 4.31 0.16 3.92 0.20 -0.76 -1.16 118.68 126.63 1qez s LEU 3016Ca -0.02 0.01 -0.30 0.00 0.69 0.00 0.00 54.13 54.51 1qez s LEU 3016Cb -0.14 -2.80 -0.08 0.00 -0.43 0.00 0.00 46.19 42.74 1qez s LEU 3016CO -0.05 -0.68 1.25 -0.69 -0.29 0.00 0.00 176.35 175.89 1qez s VAL 3017N 2.81 3.51 -0.11 1.68 1.01 0.50 -2.86 120.40 126.95 1qez s VAL 3017Ca 0.25 1.21 -0.03 0.00 0.00 0.00 0.00 61.98 63.41 1qez s VAL 3017Cb -0.14 -3.78 -0.05 0.00 0.00 0.00 0.00 36.38 32.41 1qez s VAL 3017CO 0.17 0.16 -0.12 -0.62 0.00 0.00 0.00 175.10 174.69 1qez n GLU 3018N 2.91 0.24 -4.00 2.72 1.02 0.77 0.94 120.64 125.24 1qez n GLU 3018Ca 0.06 0.09 -0.34 0.00 -0.02 0.00 0.00 57.16 56.95 1qez n GLU 3018Cb 0.44 -1.00 -0.15 0.00 -0.02 0.00 0.00 31.44 30.71 1qez n GLU 3018CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1qez s ILE 3019N -2.20 2.62 0.56 -3.67 1.01 -0.46 -4.55 121.20 114.51 1qez s ILE 3019Ca -0.15 -1.17 -0.19 0.00 0.00 0.00 0.00 60.65 59.14 1qez s ILE 3019Cb 0.05 -2.36 -0.05 0.00 0.01 0.00 0.00 42.46 40.11 1qez s ILE 3019CO 0.21 0.17 1.14 -2.16 0.00 0.00 0.00 174.94 174.30 1qez s PRO 3020N 1.27 3.24 0.45 2.79 0.04 -1.26 -0.98 135.00 140.55 1qez s PRO 3020Ca -0.02 1.64 -0.25 0.00 0.04 0.00 0.00 61.00 62.42 1qez s PRO 3020Cb -0.17 -1.99 -0.08 0.00 0.04 0.00 0.00 34.50 32.30 1qez s PRO 3020CO -0.05 -0.95 1.41 -1.14 0.04 0.00 0.00 177.00 176.31 1qez s GLN 3021N -3.34 3.68 0.00 4.56 0.74 -1.25 -2.10 119.66 121.95 1qez s GLN 3021Ca 0.73 2.38 0.00 0.00 0.05 0.00 0.00 55.36 58.52 1qez s GLN 3021Cb -0.25 -2.64 0.00 0.00 1.10 0.00 0.00 33.01 31.22 1qez s GLN 3021CO 0.29 -0.81 0.00 0.41 -0.55 0.00 0.00 175.29 174.63 1qez n GLY 3022N 0.60 2.49 3.76 2.59 0.00 0.48 -4.72 105.19 110.38 1qez n GLY 3022Ca 0.05 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.73 1qez n GLY 3022CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1qez s SER 3023N -1.91 5.07 -0.06 1.61 0.15 -0.89 -4.56 113.70 113.11 1qez s SER 3023Ca 0.00 2.22 0.09 0.00 0.70 0.00 0.00 55.95 58.95 1qez s SER 3023Cb 0.00 -2.58 0.13 0.00 -1.71 0.00 0.00 66.02 61.86 1qez s SER 3023CO 0.00 -1.66 1.02 -0.46 1.20 0.00 0.00 173.24 173.33 1qez n ASN 3024N -2.01 1.45 -4.19 5.45 6.94 -1.26 -0.83 115.26 120.81 1qez n ASN 3024Ca 0.12 -2.39 -0.33 0.00 -0.02 0.00 0.00 54.58 51.96 1qez n ASN 3024Cb 0.51 -0.24 -0.16 0.00 -2.36 0.00 0.00 39.78 37.52 1qez n ASN 3024CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 1qez s ILE 3025N -1.50 2.29 -0.72 1.53 1.01 -1.26 -1.89 121.20 120.66 1qez s ILE 3025Ca 0.15 -0.89 -0.24 0.00 0.00 0.00 0.00 60.65 59.67 1qez s ILE 3025Cb 0.13 -1.95 0.06 0.00 0.01 0.00 0.00 42.46 40.71 1qez s ILE 3025CO 0.01 0.53 1.10 -0.75 0.00 0.00 0.00 174.94 175.84 1qez s LYS 3026N 1.00 3.19 0.41 2.79 2.20 0.36 -4.92 119.74 124.77 1qez s LYS 3026Ca -0.02 -0.72 -0.12 0.00 -0.36 0.00 0.00 55.97 54.75 1qez s LYS 3026Cb -0.15 -4.32 -0.07 0.00 -1.51 0.00 0.00 37.83 31.78 1qez s LYS 3026CO -0.05 -1.94 0.79 0.71 -0.36 0.00 0.00 175.35 174.50 1qez s TYR 3027N 4.56 3.45 -0.02 4.03 2.02 -1.26 -1.14 117.35 128.99 1qez s TYR 3027Ca 0.28 1.12 0.00 0.00 -0.37 0.00 0.00 57.07 58.10 1qez s TYR 3027Cb -0.12 -2.50 0.03 0.00 -0.40 0.00 0.00 41.96 38.97 1qez s TYR 3027CO 0.09 -0.11 0.02 -2.00 -1.57 0.00 0.00 175.55 171.98 1qez s GLU 3028N -3.75 0.10 -0.15 -0.62 2.12 0.14 -4.64 118.70 111.91 1qez s GLU 3028Ca 0.53 0.14 -0.23 0.00 0.36 0.00 0.00 54.97 55.77 1qez s GLU 3028Cb -0.10 -0.35 -0.03 0.00 0.26 0.00 0.00 34.13 33.92 1qez s GLU 3028CO 0.29 -0.16 0.72 -0.47 -0.54 0.00 0.00 175.26 175.10 1qez s TYR 3029N 1.06 3.45 -0.46 5.30 5.04 -1.26 -0.11 117.35 130.37 1qez s TYR 3029Ca -0.09 1.13 -0.11 0.00 -2.44 0.00 0.00 57.07 55.56 1qez s TYR 3029Cb -0.13 -2.87 0.10 0.00 0.35 0.00 0.00 41.96 39.41 1qez s TYR 3029CO -0.02 -0.11 0.34 0.34 -1.34 0.00 0.00 175.55 174.76 1qez s ASP 3030N 1.05 5.81 0.43 4.32 -1.08 0.56 -4.95 116.67 122.81 1qez s ASP 3030Ca 0.34 -1.66 0.09 0.00 -0.52 0.00 0.00 52.55 50.80 1qez s ASP 3030Cb -0.17 -2.06 0.94 0.00 -1.46 0.00 0.00 42.92 40.18 1qez s ASP 3030CO 0.13 -0.65 2.05 -2.24 0.52 0.00 0.00 175.17 174.98 1qez h ASP 3031N 8.54 0.40 0.00 -0.34 3.04 -1.94 0.80 116.42 126.92 1qez h ASP 3031Ca -0.24 -0.01 0.00 0.00 -3.24 0.00 0.00 57.03 53.54 1qez h ASP 3031Cb 1.09 -0.10 0.00 0.00 -1.04 0.00 0.00 39.33 39.28 1qez h ASP 3031CO 0.85 0.28 0.00 -0.62 -2.04 0.00 0.00 179.24 177.71 1qez n GLU 3032N -4.48 0.00 0.30 4.15 1.02 -1.26 -3.18 120.64 117.19 1qez n GLU 3032Ca 0.04 0.37 0.18 0.00 -0.02 0.00 0.00 57.16 57.73 1qez n GLU 3032Cb 0.13 -1.34 0.91 0.00 -0.02 0.00 0.00 31.44 31.12 1qez n GLU 3032CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1qez h GLU 3033N 0.00 0.00 -1.49 3.49 5.08 -1.99 -3.46 114.58 116.20 1qez h GLU 3033Ca 0.00 0.00 -0.16 0.00 -1.00 0.00 0.00 59.36 58.20 1qez h GLU 3033Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1qez h GLU 3033CO 0.00 0.03 -0.22 0.41 -1.00 0.00 0.00 179.01 178.23 1qez n GLY 3034N -0.61 0.11 3.32 -3.84 0.00 0.27 -5.04 105.19 99.40 1qez n GLY 3034Ca -0.02 -0.50 -0.17 0.00 0.00 0.00 0.00 46.02 45.34 1qez n GLY 3034CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1qez s VAL 3035N -2.55 0.93 -0.38 1.61 -7.23 -0.99 -4.95 120.40 106.84 1qez s VAL 3035Ca 0.05 -2.02 -0.18 0.00 -1.81 0.00 0.00 61.98 58.02 1qez s VAL 3035Cb -0.02 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.55 1qez s VAL 3035CO 0.06 -0.28 0.47 -0.63 -0.31 0.00 0.00 175.10 174.40 1qez s ILE 3036N -3.49 5.05 0.20 -0.62 -1.09 -1.26 -0.32 121.20 119.66 1qez s ILE 3036Ca 0.29 0.03 0.04 0.00 -2.23 0.00 0.00 60.65 58.78 1qez s ILE 3036Cb 0.06 -3.99 -0.03 0.00 -1.58 0.00 0.00 42.46 36.92 1qez s ILE 3036CO 0.09 -0.31 0.30 -0.54 -1.23 0.00 0.00 174.94 173.26 1qez s LYS 3037N 2.29 3.36 -0.50 2.79 1.02 0.85 -4.89 119.74 124.66 1qez s LYS 3037Ca 0.16 -0.73 -0.19 0.00 0.02 0.00 0.00 55.97 55.22 1qez s LYS 3037Cb -0.16 -2.87 0.05 0.00 -0.52 0.00 0.00 37.83 34.33 1qez s LYS 3037CO 0.14 0.47 0.63 0.08 -0.92 0.00 0.00 175.35 175.74 1qez s VAL 3038N -1.88 4.87 -0.00 3.17 1.01 -1.26 -0.69 120.40 125.61 1qez s VAL 3038Ca 0.34 -0.41 -0.25 0.00 0.00 0.00 0.00 61.98 61.66 1qez s VAL 3038Cb -0.10 -4.28 -0.17 0.00 0.00 0.00 0.00 36.38 31.83 1qez s VAL 3038CO 0.28 -0.77 1.21 -0.78 0.00 0.00 0.00 175.10 175.04 1qez h ASP 3039N 8.98 -0.23 -5.42 3.32 3.58 -1.46 -3.49 116.42 121.71 1qez h ASP 3039Ca -0.27 -0.26 0.21 0.00 0.42 0.00 0.00 57.03 57.12 1qez h ASP 3039Cb 1.10 0.06 -0.09 0.00 1.72 0.00 0.00 39.33 42.12 1qez h ASP 3039CO 0.95 0.18 0.55 0.00 -2.88 0.00 0.00 179.24 178.04 1qez s ARG 3040N -4.46 1.05 -0.32 0.28 1.70 -1.19 -5.04 118.95 110.98 1qez s ARG 3040Ca -0.14 -0.59 -0.07 0.00 -0.47 0.00 0.00 55.73 54.46 1qez s ARG 3040Cb 0.02 0.36 0.02 0.00 -0.57 0.00 0.00 34.95 34.78 1qez s ARG 3040CO 0.57 -0.48 0.10 0.08 -1.08 0.00 0.00 175.30 174.48 1qez s VAL 3041N -3.09 3.93 -0.12 4.99 1.01 -1.26 -0.48 120.40 125.38 1qez s VAL 3041Ca 0.13 -0.88 -0.28 0.00 0.00 0.00 0.00 61.98 60.95 1qez s VAL 3041Cb -0.00 -3.12 -0.13 0.00 0.00 0.00 0.00 36.38 33.13 1qez s VAL 3041CO 0.01 -0.04 0.82 0.18 0.00 0.00 0.00 175.10 176.07 1qez n LEU 3042N 4.85 0.28 0.13 3.92 4.77 -0.79 -4.79 117.00 125.37 1qez n LEU 3042Ca -0.13 0.76 0.13 0.00 -0.03 0.00 0.00 56.01 56.73 1qez n LEU 3042Cb 0.46 -0.59 0.46 0.00 -2.33 0.00 0.00 43.42 41.43 1qez n LEU 3042CO 0.32 -0.99 0.87 1.88 -1.33 0.00 0.00 177.39 178.14 1qez h TYR 3043N 2.42 0.00 -2.28 -1.77 -1.99 -1.91 -3.44 116.97 108.00 1qez h TYR 3043Ca -0.31 0.00 -0.51 0.00 2.00 0.00 0.00 58.73 59.91 1qez h TYR 3043Cb 0.92 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 39.60 1qez h TYR 3043CO 0.39 0.00 -0.51 0.95 -0.00 0.00 0.00 178.16 178.99 1qez s THR 3044N -3.25 4.67 -1.28 -2.88 -4.23 -1.26 -4.97 115.64 102.42 1qez s THR 3044Ca 0.07 -1.24 -0.08 0.00 -1.18 0.00 0.00 61.69 59.26 1qez s THR 3044Cb 0.10 -3.50 -0.05 0.00 1.34 0.00 0.00 72.50 70.40 1qez s THR 3044CO 0.48 -0.30 2.88 -0.24 -0.54 0.00 0.00 174.62 176.91 1qez n SER 3045N -1.08 8.04 -4.46 3.99 2.88 -1.26 -4.87 113.62 116.85 1qez n SER 3045Ca -0.08 -2.75 -0.26 0.00 -1.33 0.00 0.00 58.87 54.45 1qez n SER 3045Cb 0.57 -1.47 -0.10 0.00 -0.75 0.00 0.00 64.21 62.46 1qez n SER 3045CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 1qez s MET 3046N 0.91 1.87 -0.05 -1.46 -1.94 -1.26 -5.17 119.30 112.20 1qez s MET 3046Ca 0.65 -2.10 -0.17 0.00 -1.71 0.00 0.00 55.69 52.36 1qez s MET 3046Cb 0.21 -1.06 0.03 0.00 2.01 0.00 0.00 34.83 36.02 1qez s MET 3046CO -0.07 -0.26 0.39 0.54 -0.01 0.00 0.00 175.02 175.61 1qez s ASN 3047N -3.62 -0.32 -0.09 3.03 4.22 -1.26 -4.60 114.94 112.29 1qez s ASN 3047Ca 0.28 0.37 -0.33 0.00 -2.14 0.00 0.00 52.86 51.04 1qez s ASN 3047Cb 0.06 0.48 -0.10 0.00 1.28 0.00 0.00 41.25 42.97 1qez s ASN 3047CO 0.14 -0.40 1.96 -1.22 -2.04 0.00 0.00 177.10 175.54 1qez n TYR 3048N 1.61 2.29 0.81 1.54 4.02 -0.01 -4.81 117.16 122.62 1qez n TYR 3048Ca -0.19 -0.10 -0.01 0.00 -0.01 0.00 0.00 57.90 57.60 1qez n TYR 3048Cb 0.56 -2.70 0.03 0.00 -0.02 0.00 0.00 39.34 37.21 1qez n TYR 3048CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 176.86 175.50 1qez n PRO 3049N 7.20 1.26 -3.63 -0.72 -0.04 -1.26 -0.39 135.00 137.43 1qez n PRO 3049Ca 0.24 -0.29 -0.02 0.00 -0.04 0.00 0.00 63.50 63.39 1qez n PRO 3049Cb 0.33 -1.38 -0.01 0.00 -0.04 0.00 0.00 33.50 32.41 1qez n PRO 3049CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1qez s PHE 3050N -0.80 -0.12 -0.01 0.54 -0.12 -1.26 -4.91 117.98 111.30 1qez s PHE 3050Ca 0.05 -0.02 -0.26 0.00 -0.05 0.00 0.00 56.93 56.65 1qez s PHE 3050Cb 0.04 0.56 -0.04 0.00 -0.63 0.00 0.00 43.02 42.95 1qez s PHE 3050CO 0.01 -0.40 0.82 -0.80 -0.05 0.00 0.00 175.22 174.81 1qez s ASN 3051N -2.71 7.20 -0.06 1.98 0.01 -0.15 -3.83 114.94 117.38 1qez s ASN 3051Ca 0.11 1.44 0.02 0.00 -0.71 0.00 0.00 52.86 53.72 1qez s ASN 3051Cb 0.01 -2.49 -0.03 0.00 0.41 0.00 0.00 41.25 39.16 1qez s ASN 3051CO -0.03 -0.13 -0.09 -0.47 -1.51 0.00 0.00 177.10 174.86 1qez s TYR 3052N 0.63 2.86 0.00 2.20 6.14 -0.15 -0.12 117.35 128.91 1qez s TYR 3052Ca 0.43 -0.04 0.00 0.00 0.64 0.00 0.00 57.07 58.10 1qez s TYR 3052Cb -0.20 -1.68 0.00 0.00 0.42 0.00 0.00 41.96 40.50 1qez s TYR 3052CO 0.23 0.29 0.00 0.41 0.64 0.00 0.00 175.55 177.12 1qez n GLY 3053N 2.22 1.31 3.11 8.97 0.00 -0.99 -0.16 105.19 119.65 1qez n GLY 3053Ca -0.18 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 44.90 1qez n GLY 3053CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1qez s PHE 3054N -4.63 0.69 -0.40 1.61 -0.12 -1.13 -0.54 117.98 113.44 1qez s PHE 3054Ca 0.00 -0.87 -0.24 0.00 -0.05 0.00 0.00 56.93 55.77 1qez s PHE 3054Cb 0.00 -0.43 0.02 0.00 -0.63 0.00 0.00 43.02 41.98 1qez s PHE 3054CO 0.00 -0.22 0.83 0.42 -0.05 0.00 0.00 175.22 176.21 1qez s ILE 3055N -3.19 4.64 0.55 -4.49 1.01 -0.37 -1.82 121.20 117.52 1qez s ILE 3055Ca 0.05 0.80 -0.21 0.00 0.00 0.00 0.00 60.65 61.29 1qez s ILE 3055Cb 0.03 -4.30 -0.05 0.00 0.01 0.00 0.00 42.46 38.15 1qez s ILE 3055CO -0.05 -0.59 1.29 -2.16 0.00 0.00 0.00 174.94 173.43 1qez s PRO 3056N 3.33 3.16 -0.16 2.79 0.04 -1.26 -3.38 135.00 139.53 1qez s PRO 3056Ca 0.33 2.07 0.00 0.00 0.04 0.00 0.00 61.00 63.44 1qez s PRO 3056Cb -0.12 -2.19 0.00 0.00 0.04 0.00 0.00 34.50 32.23 1qez s PRO 3056CO 0.20 -1.13 0.00 0.41 0.04 0.00 0.00 177.00 176.53 1qez n GLY 3057N 0.66 0.36 3.17 0.56 0.00 -1.26 -2.63 105.19 106.04 1qez n GLY 3057Ca 0.11 -0.87 -0.15 0.00 0.00 0.00 0.00 46.02 45.11 1qez n GLY 3057CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1qez s THR 3058N -2.08 0.95 -0.05 2.61 -4.23 -1.22 -4.59 115.64 107.04 1qez s THR 3058Ca 0.00 -1.53 -0.02 0.00 -1.18 0.00 0.00 61.69 58.96 1qez s THR 3058Cb 0.00 -1.24 0.03 0.00 1.34 0.00 0.00 72.50 72.63 1qez s THR 3058CO 0.00 -0.48 0.10 -0.22 -0.54 0.00 0.00 174.62 173.48 1qez s LEU 3059N -2.24 0.95 0.42 4.79 2.96 0.16 -3.90 118.68 121.82 1qez s LEU 3059Ca 0.03 0.19 0.08 0.00 -0.22 0.00 0.00 54.13 54.21 1qez s LEU 3059Cb -0.05 0.20 -0.00 0.00 0.50 0.00 0.00 46.19 46.84 1qez s LEU 3059CO 0.01 -0.13 0.48 -1.61 -1.32 0.00 0.00 176.35 173.78 1qez s GLU 3060N 1.01 2.69 0.66 1.98 0.41 0.21 -4.35 118.70 121.31 1qez s GLU 3060Ca -0.08 -1.38 0.40 0.00 -0.41 0.00 0.00 54.97 53.50 1qez s GLU 3060Cb -0.11 -2.58 2.22 0.00 -1.78 0.00 0.00 34.13 31.88 1qez s GLU 3060CO -0.04 -0.23 2.28 0.93 -0.49 0.00 0.00 175.26 177.71 1qez h GLU 3061N 0.83 0.00 -0.22 1.61 5.08 -2.00 0.07 114.58 119.95 1qez h GLU 3061Ca -0.41 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.95 1qez h GLU 3061Cb 1.27 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.52 1qez h GLU 3061CO 0.51 0.00 0.00 -0.40 -1.00 0.00 0.00 179.01 178.12 1qez n ASP 3062N -3.17 1.23 0.00 1.42 5.68 -1.26 -4.89 116.55 115.56 1qez n ASP 3062Ca -0.03 -1.93 0.00 0.00 -0.50 0.00 0.00 54.79 52.33 1qez n ASP 3062Cb 0.13 -0.14 0.00 0.00 -1.14 0.00 0.00 41.12 39.97 1qez n ASP 3062CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1qez n GLY 3063N 0.90 1.00 3.68 6.12 0.00 0.01 -5.01 105.19 111.88 1qez n GLY 3063Ca 0.09 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.87 1qez n GLY 3063CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1qez s ASP 3064N -2.94 4.78 0.91 1.61 1.01 -1.26 -4.81 116.67 115.96 1qez s ASP 3064Ca 0.00 -0.48 -0.11 0.00 0.71 0.00 0.00 52.55 52.67 1qez s ASP 3064Cb 0.00 -1.00 0.14 0.00 1.01 0.00 0.00 42.92 43.07 1qez s ASP 3064CO 0.00 0.04 1.09 -2.84 0.21 0.00 0.00 175.17 173.67 1qez s PRO 3065N -3.36 1.11 0.00 8.23 0.02 -1.25 -0.62 135.00 139.12 1qez s PRO 3065Ca 0.30 1.00 -0.30 0.00 0.02 0.00 0.00 61.00 62.01 1qez s PRO 3065Cb -0.08 -1.78 -0.04 0.00 0.02 0.00 0.00 34.50 32.62 1qez s PRO 3065CO 0.20 -2.39 1.11 -1.17 -0.33 0.00 0.00 177.00 174.42 1qez s LEU 3066N -6.36 4.34 0.55 -5.54 2.96 -1.26 -4.74 118.68 108.64 1qez s LEU 3066Ca 0.64 1.81 -0.13 0.00 -0.22 0.00 0.00 54.13 56.23 1qez s LEU 3066Cb -0.19 -3.57 -0.06 0.00 0.50 0.00 0.00 46.19 42.87 1qez s LEU 3066CO 0.58 -0.43 0.99 -1.81 -1.32 0.00 0.00 176.35 174.36 1qez s ASP 3067N 1.14 6.43 -0.00 3.68 1.01 -1.26 -1.24 116.67 126.43 1qez s ASP 3067Ca 0.55 1.46 0.00 0.00 0.71 0.00 0.00 52.55 55.27 1qez s ASP 3067Cb -0.25 -2.47 0.00 0.00 1.01 0.00 0.00 42.92 41.21 1qez s ASP 3067CO 0.26 -0.70 0.00 -0.69 0.21 0.00 0.00 175.17 174.25 1qez s VAL 3068N -2.86 0.02 -0.52 -1.27 1.01 0.30 -1.31 120.40 115.76 1qez s VAL 3068Ca 0.56 0.01 -0.10 0.00 0.00 0.00 0.00 61.98 62.46 1qez s VAL 3068Cb -0.10 -0.05 0.13 0.00 0.00 0.00 0.00 36.38 36.36 1qez s VAL 3068CO 0.42 0.02 0.41 -0.76 0.00 0.00 0.00 175.10 175.19 1qez s LEU 3069N 0.15 5.84 -0.27 3.92 1.02 0.72 -2.34 118.68 127.72 1qez s LEU 3069Ca -0.01 -2.03 -0.25 0.00 0.02 0.00 0.00 54.13 51.85 1qez s LEU 3069Cb -0.02 -2.05 0.00 0.00 0.02 0.00 0.00 46.19 44.14 1qez s LEU 3069CO -0.00 -0.69 0.88 -0.69 0.02 0.00 0.00 176.35 175.87 1qez s VAL 3070N 1.19 4.76 -0.28 -1.59 1.01 0.83 -1.67 120.40 124.66 1qez s VAL 3070Ca 0.07 1.56 -0.14 0.00 0.00 0.00 0.00 61.98 63.47 1qez s VAL 3070Cb -0.25 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 31.90 1qez s VAL 3070CO -0.01 -0.18 0.31 -0.63 0.00 0.00 0.00 175.10 174.59 1qez s ILE 3071N 3.02 5.22 0.35 2.22 1.01 0.17 -0.98 121.20 132.20 1qez s ILE 3071Ca 0.37 0.37 -0.05 0.00 0.00 0.00 0.00 60.65 61.33 1qez s ILE 3071Cb -0.15 -3.66 0.01 0.00 0.01 0.00 0.00 42.46 38.67 1qez s ILE 3071CO 0.09 0.15 0.53 0.42 0.00 0.00 0.00 174.94 176.13 1qez s THR 3072N 1.97 0.00 -0.32 2.92 -4.23 -1.26 -4.34 115.64 110.37 1qez s THR 3072Ca 0.12 -1.49 0.07 0.00 -1.18 0.00 0.00 61.69 59.21 1qez s THR 3072Cb -0.16 -2.66 0.46 0.00 1.34 0.00 0.00 72.50 71.48 1qez s THR 3072CO 0.11 0.00 1.34 -0.46 -0.54 0.00 0.00 174.62 175.06 1qez n ASN 3073N -1.36 4.35 -3.46 3.99 0.23 -1.26 -4.96 115.26 112.80 1qez n ASN 3073Ca -0.01 -3.79 -0.12 0.00 -0.53 0.00 0.00 54.58 50.14 1qez n ASN 3073Cb 0.61 -0.49 -0.02 0.00 -2.08 0.00 0.00 39.78 37.80 1qez n ASN 3073CO 0.00 0.00 0.00 -0.72 -0.93 0.00 0.00 177.26 175.61 1qez s TYR 3074N -3.52 -0.48 0.10 -2.53 -0.85 -1.26 -5.17 117.35 103.64 1qez s TYR 3074Ca 0.50 0.25 -0.01 0.00 -0.52 0.00 0.00 57.07 57.29 1qez s TYR 3074Cb 0.42 0.51 -0.04 0.00 0.38 0.00 0.00 41.96 43.23 1qez s TYR 3074CO 0.01 -0.83 0.26 1.14 -1.52 0.00 0.00 175.55 174.61 1qez s GLN 3075N -3.76 3.48 0.27 -3.49 -2.07 -1.26 -4.72 119.66 108.10 1qez s GLN 3075Ca 0.01 -0.39 0.09 0.00 -1.82 0.00 0.00 55.36 53.25 1qez s GLN 3075Cb -0.01 -2.98 -0.04 0.00 -1.09 0.00 0.00 33.01 28.89 1qez s GLN 3075CO -0.13 0.56 0.02 -0.51 -1.32 0.00 0.00 175.29 173.91 1qez s LEU 3076N -2.70 3.25 0.11 2.60 1.43 -1.26 -4.97 118.68 117.14 1qez s LEU 3076Ca 0.36 -0.61 -0.29 0.00 -1.03 0.00 0.00 54.13 52.57 1qez s LEU 3076Cb -0.12 -1.77 -0.06 0.00 0.03 0.00 0.00 46.19 44.26 1qez s LEU 3076CO 0.28 -0.01 0.90 -0.31 0.23 0.00 0.00 176.35 177.44 1qez s TYR 3077N -2.31 3.82 0.20 0.29 1.51 -1.26 -4.40 117.35 115.21 1qez s TYR 3077Ca 0.32 1.73 -0.32 0.00 -1.01 0.00 0.00 57.07 57.78 1qez s TYR 3077Cb -0.06 -2.97 -0.14 0.00 -0.11 0.00 0.00 41.96 38.67 1qez s TYR 3077CO 0.20 0.27 1.37 -2.30 -1.11 0.00 0.00 175.55 173.99 1qez n PRO 3078N 2.57 1.80 -0.44 -1.71 -0.02 -1.26 -1.28 135.00 134.67 1qez n PRO 3078Ca 0.00 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.13 1qez n PRO 3078Cb 0.49 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1qez n PRO 3078CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1qez n GLY 3079N 2.32 0.74 3.92 -1.23 0.00 0.27 -4.99 105.19 106.22 1qez n GLY 3079Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.88 1qez n GLY 3079CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1qez s SER 3080N -3.00 6.40 -0.10 1.61 1.04 -0.40 -4.82 113.70 114.43 1qez s SER 3080Ca 0.00 0.49 -0.02 0.00 0.48 0.00 0.00 55.95 56.91 1qez s SER 3080Cb 0.00 -2.05 -0.03 0.00 0.10 0.00 0.00 66.02 64.04 1qez s SER 3080CO 0.00 -0.09 -0.02 -0.69 0.98 0.00 0.00 173.24 173.41 1qez s VAL 3081N -1.94 4.07 0.04 5.02 1.01 -1.26 -0.37 120.40 126.97 1qez s VAL 3081Ca 0.40 -0.33 0.04 0.00 0.00 0.00 0.00 61.98 62.09 1qez s VAL 3081Cb -0.11 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.53 1qez s VAL 3081CO 0.29 0.57 -0.11 -0.51 0.00 0.00 0.00 175.10 175.35 1qez s ILE 3082N -0.52 0.84 -0.27 2.22 2.07 -0.30 -4.95 121.20 120.29 1qez s ILE 3082Ca 0.08 -0.98 -0.16 0.00 -1.41 0.00 0.00 60.65 58.19 1qez s ILE 3082Cb -0.12 -0.81 -0.03 0.00 0.13 0.00 0.00 42.46 41.63 1qez s ILE 3082CO 0.02 -0.14 0.42 -1.61 -1.91 0.00 0.00 174.94 171.72 1qez s GLU 3083N -1.25 4.04 0.37 3.50 2.02 -1.26 -0.94 118.70 125.18 1qez s GLU 3083Ca -0.03 0.14 0.08 0.00 0.02 0.00 0.00 54.97 55.18 1qez s GLU 3083Cb -0.08 -3.65 -0.06 0.00 0.10 0.00 0.00 34.13 30.43 1qez s GLU 3083CO 0.01 -0.30 0.02 0.14 0.02 0.00 0.00 175.26 175.15 1qez s VAL 3084N 2.14 2.32 -0.24 2.63 -7.23 -0.20 -0.60 120.40 119.23 1qez s VAL 3084Ca 0.17 -1.98 -0.02 0.00 -1.81 0.00 0.00 61.98 58.34 1qez s VAL 3084Cb -0.16 -2.86 0.02 0.00 0.56 0.00 0.00 36.38 33.94 1qez s VAL 3084CO 0.10 -0.11 -0.06 -0.13 -0.31 0.00 0.00 175.10 174.58 1qez s ARG 3085N -3.73 3.01 0.23 4.82 0.52 0.80 -1.52 118.95 123.09 1qez s ARG 3085Ca 0.36 -0.86 -0.30 0.00 -0.52 0.00 0.00 55.73 54.41 1qez s ARG 3085Cb 0.04 -2.97 -0.09 0.00 0.52 0.00 0.00 34.95 32.45 1qez s ARG 3085CO 0.19 -0.33 1.31 -2.14 0.02 0.00 0.00 175.30 174.36 1qez s PRO 3086N 1.37 4.38 0.00 3.54 0.02 -1.26 -2.12 135.00 140.94 1qez s PRO 3086Ca 0.02 2.10 0.00 0.00 0.02 0.00 0.00 61.00 63.14 1qez s PRO 3086Cb -0.16 -3.16 0.00 0.00 0.02 0.00 0.00 34.50 31.20 1qez s PRO 3086CO -0.05 -0.23 0.27 0.44 -0.33 0.00 0.00 177.00 177.09 1qez n ILE 3087N 2.21 0.00 -2.17 2.83 -5.35 0.47 -4.85 119.36 112.50 1qez n ILE 3087Ca 0.05 -0.46 0.00 0.00 -0.27 0.00 0.00 62.75 62.07 1qez n ILE 3087Cb 0.42 1.05 0.00 0.00 -1.74 0.00 0.00 39.64 39.37 1qez n ILE 3087CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1qez n GLY 3088N 0.39 -1.24 3.20 3.28 0.00 -0.96 -0.37 105.19 109.49 1qez n GLY 3088Ca 0.00 -0.89 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 1qez n GLY 3088CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1qez s ILE 3089N -2.71 0.04 -0.16 -0.61 2.07 -1.01 -1.30 121.20 117.52 1qez s ILE 3089Ca 0.00 -0.32 0.01 0.00 -1.41 0.00 0.00 60.65 58.93 1qez s ILE 3089Cb 0.00 -0.52 0.01 0.00 0.13 0.00 0.00 42.46 42.08 1qez s ILE 3089CO 0.00 -0.18 -0.18 -0.22 -1.91 0.00 0.00 174.94 172.45 1qez s LEU 3090N -0.76 2.29 -0.15 8.50 2.96 0.35 -0.12 118.68 131.74 1qez s LEU 3090Ca -0.08 -0.56 -0.10 0.00 -0.22 0.00 0.00 54.13 53.17 1qez s LEU 3090Cb -0.04 -1.51 -0.05 0.00 0.50 0.00 0.00 46.19 45.09 1qez s LEU 3090CO 0.02 0.05 0.17 -0.31 -1.32 0.00 0.00 176.35 174.96 1qez s TYR 3091N 1.03 3.51 0.23 5.38 2.02 0.45 -1.17 117.35 128.79 1qez s TYR 3091Ca -0.01 0.48 -0.15 0.00 -0.37 0.00 0.00 57.07 57.02 1qez s TYR 3091Cb -0.15 -2.11 0.01 0.00 -0.40 0.00 0.00 41.96 39.32 1qez s TYR 3091CO -0.05 0.48 0.50 0.00 -1.57 0.00 0.00 175.55 174.91 1qez s MET 3092N -0.25 1.49 -0.03 -0.62 0.23 0.15 0.29 119.30 120.56 1qez s MET 3092Ca 0.13 -1.10 0.01 0.00 -1.03 0.00 0.00 55.69 53.70 1qez s MET 3092Cb -0.12 0.49 0.01 0.00 -1.53 0.00 0.00 34.83 33.69 1qez s MET 3092CO 0.02 -0.63 -0.05 0.15 -2.03 0.00 0.00 175.02 172.49 1qez s LYS 3093N -3.96 0.63 0.12 3.16 1.02 0.07 -0.59 119.74 120.19 1qez s LYS 3093Ca 0.16 -0.13 0.01 0.00 0.02 0.00 0.00 55.97 56.03 1qez s LYS 3093Cb -0.01 -0.65 -0.00 0.00 -0.52 0.00 0.00 37.83 36.65 1qez s LYS 3093CO 0.04 -0.00 0.02 -0.40 -0.92 0.00 0.00 175.35 174.09 1qez n ASP 3094N 3.61 1.55 0.27 2.83 5.68 0.34 -0.37 116.55 130.47 1qez n ASP 3094Ca -0.21 -1.58 0.18 0.00 -0.50 0.00 0.00 54.79 52.69 1qez n ASP 3094Cb 0.53 0.20 0.94 0.00 -1.14 0.00 0.00 41.12 41.66 1qez n ASP 3094CO 0.00 0.00 0.00 1.05 -1.33 0.00 0.00 177.20 176.92 1qez h GLU 3095N 0.00 0.00 0.00 0.11 9.09 -1.83 -0.90 114.58 121.05 1qez h GLU 3095Ca -0.09 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.32 1qez h GLU 3095Cb 0.33 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.43 1qez h GLU 3095CO 0.15 0.00 -0.94 0.93 0.05 0.00 0.00 179.01 179.20 1qez h GLU 3096N 0.00 0.00 0.00 1.06 4.39 -1.95 -3.51 114.58 114.57 1qez h GLU 3096Ca 0.04 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1qez h GLU 3096Cb 0.33 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.98 1qez h GLU 3096CO -0.00 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.26 1qez n GLY 3097N 1.20 0.45 3.82 -3.84 0.00 -0.34 -5.09 105.19 101.39 1qez n GLY 3097Ca 0.00 -1.59 -0.33 0.00 0.00 0.00 0.00 46.02 44.11 1qez n GLY 3097CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1qez s GLU 3098N -1.39 4.12 -0.06 1.61 2.12 -1.26 -0.50 118.70 123.34 1qez s GLU 3098Ca 0.00 1.10 -0.31 0.00 0.36 0.00 0.00 54.97 56.13 1qez s GLU 3098Cb 0.00 -2.16 0.07 0.00 0.26 0.00 0.00 34.13 32.30 1qez s GLU 3098CO 0.00 -0.13 0.69 0.34 -0.54 0.00 0.00 175.26 175.62 1qez s ASP 3099N -2.37 -0.66 -0.01 -1.70 -1.08 0.25 -4.90 116.67 106.21 1qez s ASP 3099Ca 0.62 0.74 0.01 0.00 -0.52 0.00 0.00 52.55 53.40 1qez s ASP 3099Cb -0.10 0.57 -0.00 0.00 -1.46 0.00 0.00 42.92 41.93 1qez s ASP 3099CO 0.18 -0.59 -0.04 0.00 0.52 0.00 0.00 175.17 175.24 1qez s ALA 3100N -1.13 0.35 -0.08 3.66 0.00 -1.26 -0.68 121.76 122.63 1qez s ALA 3100Ca -0.10 -0.16 0.01 0.00 0.00 0.00 0.00 51.96 51.70 1qez s ALA 3100Cb -0.00 -0.10 0.02 0.00 0.00 0.00 0.00 23.12 23.03 1qez s ALA 3100CO 0.09 0.08 -0.10 0.15 0.00 0.00 0.00 175.76 175.99 1qez s LYS 3101N -0.03 1.51 0.44 0.00 1.02 -0.32 -4.56 119.74 117.80 1qez s LYS 3101Ca 0.01 -0.32 -0.24 0.00 0.02 0.00 0.00 55.97 55.45 1qez s LYS 3101Cb -0.02 -1.37 -0.08 0.00 -0.52 0.00 0.00 37.83 35.84 1qez s LYS 3101CO -0.00 -0.08 1.18 0.42 -0.92 0.00 0.00 175.35 175.95 1qez s ILE 3102N 1.01 3.04 -0.14 2.17 -1.09 -0.43 -0.50 121.20 125.27 1qez s ILE 3102Ca -0.08 0.82 0.01 0.00 -2.23 0.00 0.00 60.65 59.16 1qez s ILE 3102Cb -0.15 -3.43 -0.00 0.00 -1.58 0.00 0.00 42.46 37.30 1qez s ILE 3102CO -0.00 0.02 -0.16 -0.69 -1.23 0.00 0.00 174.94 172.87 1qez s VAL 3103N -1.48 2.64 0.15 2.92 1.01 -0.42 -0.20 120.40 125.01 1qez s VAL 3103Ca 0.62 -0.79 -0.06 0.00 0.00 0.00 0.00 61.98 61.75 1qez s VAL 3103Cb -0.30 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 33.96 1qez s VAL 3103CO 0.37 0.53 0.19 0.00 0.00 0.00 0.00 175.10 176.18 1qez s ALA 3104N 0.61 0.35 0.25 5.51 0.00 -0.67 -0.40 121.76 127.40 1qez s ALA 3104Ca -0.09 -1.12 0.08 0.00 0.00 0.00 0.00 51.96 50.83 1qez s ALA 3104Cb -0.16 0.85 -0.05 0.00 0.00 0.00 0.00 23.12 23.76 1qez s ALA 3104CO 0.03 -0.58 -0.13 0.14 0.00 0.00 0.00 175.76 175.23 1qez s VAL 3105N -4.00 1.86 0.58 0.00 -7.23 -0.90 -0.65 120.40 110.06 1qez s VAL 3105Ca 0.19 -2.22 -0.20 0.00 -1.81 0.00 0.00 61.98 57.94 1qez s VAL 3105Cb 0.05 -2.23 -0.03 0.00 0.56 0.00 0.00 36.38 34.72 1qez s VAL 3105CO 0.00 -0.46 1.34 -2.84 -0.31 0.00 0.00 175.10 172.83 1qez s PRO 3106N -3.64 2.92 0.59 4.82 0.02 -1.26 -0.14 135.00 138.31 1qez s PRO 3106Ca 0.26 2.18 -0.20 0.00 0.02 0.00 0.00 61.00 63.27 1qez s PRO 3106Cb -0.00 -2.11 -0.03 0.00 0.02 0.00 0.00 34.50 32.38 1qez s PRO 3106CO 0.10 -1.34 1.32 -1.59 -0.33 0.00 0.00 177.00 175.15 1qez s LYS 3107N -3.08 2.88 0.28 5.54 -2.85 0.23 -4.53 119.74 118.21 1qez s LYS 3107Ca 0.76 2.12 -0.02 0.00 -1.00 0.00 0.00 55.97 57.83 1qez s LYS 3107Cb -0.40 -2.06 0.60 0.00 -2.06 0.00 0.00 37.83 33.92 1qez s LYS 3107CO 0.45 -1.36 1.61 -0.44 0.10 0.00 0.00 175.35 175.72 1qez h ASP 3108N 1.03 -0.35 0.09 0.03 5.19 -1.91 0.04 116.42 120.54 1qez h ASP 3108Ca -0.51 0.23 -0.07 0.00 -0.62 0.00 0.00 57.03 56.06 1qez h ASP 3108Cb 1.32 0.39 -0.01 0.00 0.18 0.00 0.00 39.33 41.20 1qez h ASP 3108CO 0.55 -0.24 -0.21 0.11 -3.12 0.00 0.00 179.24 176.33 1qez h LYS 3109N 0.09 0.23 -0.26 3.56 1.57 -1.98 -1.08 116.57 118.70 1qez h LYS 3109Ca 0.50 -0.07 -0.20 0.00 -1.87 0.00 0.00 60.65 59.02 1qez h LYS 3109Cb 0.97 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.26 1qez h LYS 3109CO -0.76 0.44 -0.60 1.15 -0.57 0.00 0.00 179.45 179.10 1qez h THR 3110N 0.21 1.27 -1.38 -0.16 2.02 -1.35 -3.42 112.91 110.11 1qez h THR 3110Ca 0.04 -1.78 -0.19 0.00 0.77 0.00 0.00 66.41 65.25 1qez h THR 3110Cb 0.50 1.70 -0.24 0.00 -1.74 0.00 0.00 68.15 68.38 1qez h THR 3110CO 0.03 0.58 -0.55 -0.62 0.37 0.00 0.00 175.52 175.33 1qez s ASP 3111N -6.99 -0.46 0.00 4.18 -1.08 -0.83 -5.01 116.67 106.48 1qez s ASP 3111Ca -0.11 -1.14 0.03 0.00 -0.52 0.00 0.00 52.55 50.82 1qez s ASP 3111Cb 0.10 1.40 0.19 0.00 -1.46 0.00 0.00 42.92 43.14 1qez s ASP 3111CO 0.90 -0.20 0.77 -0.81 0.52 0.00 0.00 175.17 176.35 1qez n PRO 3112N 4.30 0.08 -0.03 4.34 -0.04 -0.43 -2.64 135.00 140.59 1qez n PRO 3112Ca 0.11 0.10 0.12 0.00 -0.04 0.00 0.00 63.50 63.79 1qez n PRO 3112Cb 0.52 -1.50 0.55 0.00 -0.04 0.00 0.00 33.50 33.03 1qez n PRO 3112CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1qez n SER 3113N -1.11 0.93 -0.23 3.54 3.41 -1.26 -3.15 113.62 115.76 1qez n SER 3113Ca 0.02 -1.47 0.04 0.00 -0.26 0.00 0.00 58.87 57.20 1qez n SER 3113Cb 0.02 -0.04 0.08 0.00 -0.26 0.00 0.00 64.21 64.01 1qez n SER 3113CO 0.00 0.00 0.00 0.49 -0.16 0.00 0.00 175.04 175.37 1qez n PHE 3114N -0.21 0.18 0.25 7.33 3.72 -1.08 -4.71 117.46 122.94 1qez n PHE 3114Ca 0.18 -0.62 0.09 0.00 -0.05 0.00 0.00 57.45 57.05 1qez n PHE 3114Cb 0.23 -0.08 0.63 0.00 -0.94 0.00 0.00 39.48 39.32 1qez n PHE 3114CO 0.00 0.00 0.00 0.77 -0.05 0.00 0.00 176.76 177.48 1qez h SER 3115N 0.60 0.00 1.83 4.37 0.02 -1.74 -2.56 113.55 116.06 1qez h SER 3115Ca 0.00 0.00 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1qez h SER 3115Cb 0.72 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.26 1qez h SER 3115CO 0.02 0.14 -0.00 -0.55 -1.14 0.00 0.00 176.83 175.30 1qez h ASN 3116N 0.00 0.00 -2.34 3.07 7.08 -1.85 -3.40 115.58 118.13 1qez h ASN 3116Ca -0.00 0.00 -0.64 0.00 -3.08 0.00 0.00 56.30 52.58 1qez h ASN 3116Cb 0.30 0.00 -0.14 0.00 -2.08 0.00 0.00 38.32 36.40 1qez h ASN 3116CO 0.02 0.00 0.81 -0.63 -2.08 0.00 0.00 177.43 175.55 1qez s ILE 3117N -3.29 4.36 -0.18 6.14 -1.09 -0.97 -4.79 121.20 121.39 1qez s ILE 3117Ca 0.06 -0.76 0.18 0.00 -2.23 0.00 0.00 60.65 57.90 1qez s ILE 3117Cb 0.06 -4.79 -0.26 0.00 -1.58 0.00 0.00 42.46 35.89 1qez s ILE 3117CO 0.65 -1.57 0.46 0.29 -1.23 0.00 0.00 174.94 173.54 1qez n LYS 3118N 7.61 0.68 -3.89 2.79 5.02 -1.26 -4.98 118.16 124.14 1qez n LYS 3118Ca 0.11 -0.13 -0.09 0.00 -2.02 0.00 0.00 58.31 56.18 1qez n LYS 3118Cb 0.48 -1.40 -0.07 0.00 -0.02 0.00 0.00 35.03 34.01 1qez n LYS 3118CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1qez s ASP 3119N -3.78 0.08 0.54 4.39 -1.08 -1.26 -4.70 116.67 110.85 1qez s ASP 3119Ca -0.04 -0.72 0.33 0.00 -0.52 0.00 0.00 52.55 51.60 1qez s ASP 3119Cb 0.12 0.38 1.50 0.00 -1.46 0.00 0.00 42.92 43.46 1qez s ASP 3119CO 0.74 -0.80 1.85 -0.29 0.52 0.00 0.00 175.17 177.19 1qez h ILE 3120N 2.66 0.49 0.00 4.11 6.09 -1.00 0.30 117.51 130.16 1qez h ILE 3120Ca -0.33 -0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.16 1qez h ILE 3120Cb 1.21 0.48 0.00 0.00 0.47 0.00 0.00 36.82 38.98 1qez h ILE 3120CO 0.53 0.00 0.00 0.59 -3.07 0.00 0.00 178.15 176.20 1qez n ASN 3121N -4.24 0.00 0.05 2.19 3.02 -1.26 -2.70 115.26 112.32 1qez n ASN 3121Ca 0.22 -0.86 0.12 0.00 -0.03 0.00 0.00 54.58 54.03 1qez n ASN 3121Cb 1.08 -0.04 0.23 0.00 -0.61 0.00 0.00 39.78 40.44 1qez n ASN 3121CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 1qez n ASP 3122N -1.04 0.62 -4.75 6.41 8.00 0.10 -4.86 116.55 121.04 1qez n ASP 3122Ca 0.22 0.10 -0.40 0.00 0.71 0.00 0.00 54.79 55.42 1qez n ASP 3122Cb 0.12 0.07 -0.06 0.00 -0.02 0.00 0.00 41.12 41.23 1qez n ASP 3122CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1qez s LEU 3123N -3.91 4.57 0.53 0.64 1.43 -1.10 -4.93 118.68 115.91 1qez s LEU 3123Ca 0.08 1.75 -0.22 0.00 -1.03 0.00 0.00 54.13 54.71 1qez s LEU 3123Cb 0.15 -3.45 -0.06 0.00 0.03 0.00 0.00 46.19 42.85 1qez s LEU 3123CO 0.69 0.11 1.24 -2.65 0.23 0.00 0.00 176.35 175.98 1qez n PRO 3124N 1.98 1.56 -0.33 1.29 -0.02 -1.26 -4.84 135.00 133.38 1qez n PRO 3124Ca -0.02 0.57 0.03 0.00 -2.02 0.00 0.00 63.50 62.06 1qez n PRO 3124Cb 0.48 -2.43 0.18 0.00 -0.02 0.00 0.00 33.50 31.72 1qez n PRO 3124CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1qez h GLN 3125N 1.37 0.92 -0.96 -0.52 5.75 -1.95 -1.59 115.11 118.13 1qez h GLN 3125Ca -0.49 -0.06 0.08 0.00 -0.15 0.00 0.00 58.65 58.04 1qez h GLN 3125Cb 1.32 -0.21 -0.07 0.00 1.07 0.00 0.00 27.48 29.59 1qez h GLN 3125CO 0.56 0.61 0.62 0.00 -2.65 0.00 0.00 178.83 177.97 1qez h ALA 3126N 1.46 1.50 -0.49 3.38 0.00 -1.99 -0.47 119.26 122.65 1qez h ALA 3126Ca 0.42 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.20 1qez h ALA 3126Cb 0.31 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1qez h ALA 3126CO -0.22 0.32 -0.19 1.15 0.00 0.00 0.00 179.25 180.31 1qez h THR 3127N 1.05 1.27 -0.40 0.00 2.02 -1.65 -1.64 112.91 113.55 1qez h THR 3127Ca 0.44 -1.35 -0.07 0.00 0.77 0.00 0.00 66.41 66.20 1qez h THR 3127Cb 0.30 1.09 -0.01 0.00 -1.74 0.00 0.00 68.15 67.78 1qez h THR 3127CO -0.19 0.47 -0.03 0.11 0.37 0.00 0.00 175.52 176.25 1qez h LYS 3128N 0.86 0.72 -0.87 6.66 1.57 -1.00 -1.91 116.57 122.60 1qez h LYS 3128Ca 0.12 -0.24 -0.02 0.00 -1.87 0.00 0.00 60.65 58.64 1qez h LYS 3128Cb 0.76 -0.06 -0.04 0.00 0.08 0.00 0.00 32.23 32.97 1qez h LYS 3128CO 0.06 0.82 0.48 -0.91 -0.57 0.00 0.00 179.45 179.33 1qez h ASN 3129N 0.54 1.08 -0.13 0.86 2.35 -1.03 -0.60 115.58 118.66 1qez h ASN 3129Ca 0.11 -0.10 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1qez h ASN 3129Cb 0.52 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.60 1qez h ASN 3129CO 0.03 0.87 0.07 0.50 -1.65 0.00 0.00 177.43 177.25 1qez h LYS 3130N 1.21 0.18 -0.32 0.81 3.64 -1.10 0.09 116.57 121.08 1qez h LYS 3130Ca 0.31 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.66 1qez h LYS 3130Cb 0.03 -0.03 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1qez h LYS 3130CO -0.05 0.20 0.18 0.82 -2.27 0.00 0.00 179.45 178.33 1qez h ILE 3131N 0.11 1.12 -0.20 2.00 2.04 -1.05 -0.05 117.51 121.49 1qez h ILE 3131Ca 0.04 -0.31 -0.00 0.00 1.00 0.00 0.00 64.86 65.60 1qez h ILE 3131Cb 0.07 0.75 -0.01 0.00 -0.74 0.00 0.00 36.82 36.90 1qez h ILE 3131CO -0.01 0.12 0.12 0.58 0.00 0.00 0.00 178.15 178.96 1qez h VAL 3132N 0.40 1.09 -0.89 1.67 2.07 -1.00 -2.30 116.25 117.29 1qez h VAL 3132Ca 0.11 -0.24 0.02 0.00 0.82 0.00 0.00 66.70 67.42 1qez h VAL 3132Cb 0.04 0.89 -0.05 0.00 -1.52 0.00 0.00 31.29 30.65 1qez h VAL 3132CO -0.02 0.09 0.59 -0.74 0.02 0.00 0.00 177.57 177.51 1qez h HIS 3133N 0.23 1.10 0.48 1.57 -0.00 -0.80 -2.25 115.15 115.49 1qez h HIS 3133Ca 0.07 0.03 -0.02 0.00 -0.00 0.00 0.00 60.37 60.45 1qez h HIS 3133Cb 0.04 -0.37 -0.01 0.00 -0.00 0.00 0.00 27.41 27.07 1qez h HIS 3133CO -0.04 0.67 -0.32 0.35 -0.00 0.00 0.00 177.93 178.58 1qez h PHE 3134N 1.17 -0.85 -0.48 5.26 3.57 -0.52 -2.36 116.94 122.72 1qez h PHE 3134Ca 0.34 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.87 1qez h PHE 3134Cb -0.06 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 38.96 1qez h PHE 3134CO -0.00 -0.49 0.32 0.74 -2.23 0.00 0.00 178.31 176.66 1qez h PHE 3135N -0.78 0.50 -0.00 0.41 0.04 -1.21 -0.61 116.94 115.30 1qez h PHE 3135Ca -0.05 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1qez h PHE 3135Cb 0.65 -0.17 0.00 0.00 2.20 0.00 0.00 35.95 38.63 1qez h PHE 3135CO -0.12 0.29 -0.05 0.39 -0.60 0.00 0.00 178.31 178.23 1qez n GLU 3136N -4.47 0.56 0.00 1.51 1.02 -0.87 -4.27 120.64 114.12 1qez n GLU 3136Ca 0.06 -0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.11 1qez n GLU 3136Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.09 1qez n GLU 3136CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1qez n HIS 3137N -1.14 0.00 0.30 -0.32 8.25 -0.76 -4.75 115.22 116.81 1qez n HIS 3137Ca 0.15 0.00 0.18 0.00 -0.26 0.00 0.00 57.72 57.79 1qez n HIS 3137Cb 0.25 0.00 0.79 0.00 1.12 0.00 0.00 29.99 32.15 1qez n HIS 3137CO 0.00 0.00 0.00 0.10 0.64 0.00 0.00 176.34 177.08 1qez h TYR 3138N 0.00 0.00 -0.01 4.41 -0.00 -1.32 -2.96 116.97 117.09 1qez h TYR 3138Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.73 1qez h TYR 3138Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1qez h TYR 3138CO 0.00 0.00 -0.36 1.63 -0.00 0.00 0.00 178.16 179.43 1qez n LYS 3139N -2.96 2.02 -0.37 0.10 5.02 -1.26 -4.43 118.16 116.28 1qez n LYS 3139Ca -0.00 -0.56 0.01 0.00 -2.02 0.00 0.00 58.31 55.73 1qez n LYS 3139Cb 0.23 -1.18 0.07 0.00 -0.02 0.00 0.00 35.03 34.13 1qez n LYS 3139CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1qez h GLU 3140N 1.18 -0.01 0.00 1.97 5.08 -1.78 0.35 114.58 121.38 1qez h GLU 3140Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1qez h GLU 3140Cb 0.43 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1qez h GLU 3140CO 0.00 -0.01 0.00 1.28 -1.00 0.00 0.00 179.01 179.28 1qez n LEU 3141N -5.52 0.00 -4.67 1.33 4.77 -1.26 -4.63 117.00 107.03 1qez n LEU 3141Ca 0.12 0.24 -0.40 0.00 -0.03 0.00 0.00 56.01 55.94 1qez n LEU 3141Cb 0.43 -0.24 -0.06 0.00 -2.33 0.00 0.00 43.42 41.22 1qez n LEU 3141CO -0.12 -0.13 0.34 -1.61 -1.33 0.00 0.00 177.39 174.53 1qez s GLU 3142N -2.48 4.24 -0.20 3.23 2.02 0.12 -5.00 118.70 120.63 1qez s GLU 3142Ca 0.14 0.59 -0.36 0.00 0.02 0.00 0.00 54.97 55.37 1qez s GLU 3142Cb 0.09 -3.55 -0.12 0.00 0.10 0.00 0.00 34.13 30.65 1qez s GLU 3142CO 0.20 -0.17 1.94 -0.35 0.02 0.00 0.00 175.26 176.90 1qez n PRO 3143N 4.80 1.68 -0.99 0.39 -0.04 -1.26 -2.31 135.00 137.27 1qez n PRO 3143Ca -0.02 0.58 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 1qez n PRO 3143Cb 0.50 -2.51 0.00 0.00 -0.04 0.00 0.00 33.50 31.45 1qez n PRO 3143CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1qez n GLY 3144N 4.91 0.56 3.73 0.55 0.00 -1.26 -5.03 105.19 108.65 1qez n GLY 3144Ca 0.28 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.99 1qez n GLY 3144CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1qez s LYS 3145N -0.16 2.78 -0.04 1.61 3.01 -0.98 -4.82 119.74 121.15 1qez s LYS 3145Ca 0.00 -0.70 -0.29 0.00 -1.01 0.00 0.00 55.97 53.96 1qez s LYS 3145Cb 0.00 -2.67 0.11 0.00 -1.01 0.00 0.00 37.83 34.26 1qez s LYS 3145CO 0.00 0.57 0.92 1.52 0.51 0.00 0.00 175.35 178.87 1qez s TYR 3146N -1.30 -0.34 -0.06 3.18 -0.85 -1.26 -4.62 117.35 112.09 1qez s TYR 3146Ca 0.26 0.28 -0.05 0.00 -0.52 0.00 0.00 57.07 57.04 1qez s TYR 3146Cb -0.12 0.52 0.02 0.00 0.38 0.00 0.00 41.96 42.76 1qez s TYR 3146CO 0.18 -0.49 0.16 0.08 -1.52 0.00 0.00 175.55 173.96 1qez s VAL 3147N -2.74 -0.01 -0.07 -3.49 1.01 -1.26 -2.73 120.40 111.11 1qez s VAL 3147Ca 0.04 0.03 -0.00 0.00 0.00 0.00 0.00 61.98 62.04 1qez s VAL 3147Cb -0.01 -0.24 0.03 0.00 0.00 0.00 0.00 36.38 36.16 1qez s VAL 3147CO -0.07 0.01 -0.02 -1.59 0.00 0.00 0.00 175.10 173.43 1qez s LYS 3148N 0.26 0.78 -0.11 2.72 -2.85 0.50 -4.53 119.74 116.51 1qez s LYS 3148Ca -0.01 -0.00 -0.30 0.00 -1.00 0.00 0.00 55.97 54.66 1qez s LYS 3148Cb -0.03 -0.99 -0.02 0.00 -2.06 0.00 0.00 37.83 34.74 1qez s LYS 3148CO -0.01 -0.22 1.09 0.42 0.10 0.00 0.00 175.35 176.73 1qez s ILE 3149N 1.59 4.57 -0.12 3.79 -1.09 -1.26 -0.75 121.20 127.93 1qez s ILE 3149Ca -0.00 1.87 -0.18 0.00 -2.23 0.00 0.00 60.65 60.10 1qez s ILE 3149Cb -0.13 -4.20 -0.16 0.00 -1.58 0.00 0.00 42.46 36.39 1qez s ILE 3149CO -0.04 -0.03 0.52 0.28 -1.23 0.00 0.00 174.94 174.45 1qez h SER 3150N 7.32 -0.02 0.00 3.58 0.02 -0.50 -3.48 113.55 120.48 1qez h SER 3150Ca -0.30 -0.58 0.00 0.00 -0.84 0.00 0.00 61.79 60.07 1qez h SER 3150Cb 1.14 0.01 0.00 0.00 0.14 0.00 0.00 62.40 63.68 1qez h SER 3150CO 0.89 0.75 0.00 0.61 -1.14 0.00 0.00 176.83 177.94 1qez n GLY 3151N 1.54 -1.54 3.82 -3.77 0.00 -1.07 -5.00 105.19 99.16 1qez n GLY 3151Ca -0.06 -1.05 -0.23 0.00 0.00 0.00 0.00 46.02 44.68 1qez n GLY 3151CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1qez s TRP 3152N -2.52 3.12 0.17 1.61 0.52 -1.26 -0.41 118.94 120.17 1qez s TRP 3152Ca 0.00 -0.09 0.07 0.00 0.02 0.00 0.00 56.10 56.10 1qez s TRP 3152Cb 0.00 -1.43 -0.04 0.00 -1.15 0.00 0.00 33.47 30.85 1qez s TRP 3152CO 0.00 0.52 -0.14 0.20 0.02 0.00 0.00 176.95 177.55 1qez s GLY 3153N -3.67 1.27 0.84 0.98 0.00 0.83 -4.93 107.32 102.64 1qez s GLY 3153Ca 0.32 -1.52 -0.13 0.00 0.00 0.00 0.00 44.72 43.39 1qez s GLY 3153CO 0.25 -1.61 1.20 -1.35 0.00 0.00 0.00 173.10 171.59 1qez s SER 3154N -3.02 4.21 0.23 1.64 1.04 -1.26 -2.41 113.70 114.14 1qez s SER 3154Ca 0.17 0.65 -0.07 0.00 0.48 0.00 0.00 55.95 57.19 1qez s SER 3154Cb -0.02 -1.05 0.27 0.00 0.10 0.00 0.00 66.02 65.32 1qez s SER 3154CO 0.05 -2.08 1.88 0.00 0.98 0.00 0.00 173.24 174.07 1qez h ALA 3155N -1.17 1.14 -0.75 5.32 0.00 -1.86 -1.06 119.26 120.88 1qez h ALA 3155Ca -0.46 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.44 1qez h ALA 3155Cb 1.31 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.77 1qez h ALA 3155CO 0.60 0.39 0.49 1.15 0.00 0.00 0.00 179.25 181.88 1qez h THR 3156N 1.07 1.17 0.12 0.00 2.02 -1.92 0.12 112.91 115.48 1qez h THR 3156Ca 0.35 -0.34 -0.00 0.00 0.77 0.00 0.00 66.41 67.18 1qez h THR 3156Cb 0.02 0.09 -0.00 0.00 -1.74 0.00 0.00 68.15 66.51 1qez h THR 3156CO -0.12 0.18 -0.07 -0.08 0.37 0.00 0.00 175.52 175.80 1qez h GLU 3157N 0.99 -0.18 -0.60 6.66 4.81 -1.75 -2.49 114.58 122.03 1qez h GLU 3157Ca 0.28 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.59 1qez h GLU 3157Cb -0.08 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.29 1qez h GLU 3157CO -0.08 -0.12 0.31 0.00 -0.73 0.00 0.00 179.01 178.39 1qez h ALA 3158N 0.69 0.79 -0.48 2.92 0.00 -0.57 -1.61 119.26 121.00 1qez h ALA 3158Ca -0.01 0.03 0.06 0.00 0.00 0.00 0.00 54.91 54.99 1qez h ALA 3158Cb 0.16 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1qez h ALA 3158CO 0.01 -0.05 0.32 0.87 0.00 0.00 0.00 179.25 180.41 1qez h LYS 3159N 0.57 0.42 -0.07 0.00 6.56 -0.54 -1.91 116.57 121.59 1qez h LYS 3159Ca 0.27 -0.03 -0.04 0.00 -1.06 0.00 0.00 60.65 59.80 1qez h LYS 3159Cb 0.21 -0.09 -0.00 0.00 -0.57 0.00 0.00 32.23 31.77 1qez h LYS 3159CO -0.20 0.28 -0.11 -0.91 -2.06 0.00 0.00 179.45 176.45 1qez h ASN 3160N 0.43 0.22 -0.89 0.86 4.21 -0.86 -2.06 115.58 117.47 1qez h ASN 3160Ca 0.21 -0.54 0.12 0.00 1.21 0.00 0.00 56.30 57.29 1qez h ASN 3160Cb 0.28 -0.06 -0.08 0.00 -1.12 0.00 0.00 38.32 37.34 1qez h ASN 3160CO -0.05 0.71 0.52 -0.09 -1.29 0.00 0.00 177.43 177.23 1qez h ARG 3161N -0.28 0.81 -0.59 0.81 9.65 -0.94 0.00 114.38 123.84 1qez h ARG 3161Ca 0.01 -0.05 -0.10 0.00 -1.10 0.00 0.00 59.98 58.74 1qez h ARG 3161Cb 0.67 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 29.05 1qez h ARG 3161CO 0.03 0.53 -0.00 0.82 2.80 0.00 0.00 179.97 184.15 1qez h ILE 3162N 0.83 1.27 -0.16 1.20 2.04 -1.33 -1.21 117.51 120.15 1qez h ILE 3162Ca 0.45 -1.15 0.03 0.00 1.00 0.00 0.00 64.86 65.19 1qez h ILE 3162Cb 0.47 0.82 -0.03 0.00 -0.74 0.00 0.00 36.82 37.35 1qez h ILE 3162CO -0.28 0.42 -0.01 1.56 0.00 0.00 0.00 178.15 179.84 1qez h GLN 3163N 0.95 0.04 0.11 2.37 1.08 -0.30 -1.14 115.11 118.22 1qez h GLN 3163Ca 0.17 -0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.36 1qez h GLN 3163Cb 0.56 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.98 1qez h GLN 3163CO 0.03 0.03 -0.05 -0.07 -0.95 0.00 0.00 178.83 177.81 1qez h LEU 3164N 0.04 -0.13 -1.53 1.46 3.38 -1.14 -0.74 115.31 116.65 1qez h LEU 3164Ca 0.08 -0.16 0.22 0.00 0.09 0.00 0.00 57.88 58.10 1qez h LEU 3164Cb 0.10 0.03 -0.07 0.00 0.09 0.00 0.00 40.66 40.82 1qez h LEU 3164CO -0.14 0.09 0.61 0.00 0.09 0.00 0.00 178.44 179.09 1qez h ALA 3165N 0.52 2.27 0.03 1.53 0.00 -1.07 0.67 119.26 123.20 1qez h ALA 3165Ca -0.02 0.02 -0.18 0.00 0.00 0.00 0.00 54.91 54.73 1qez h ALA 3165Cb 0.28 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.08 1qez h ALA 3165CO 0.03 -0.57 -0.72 0.82 0.00 0.00 0.00 179.25 178.81 1qez h ILE 3166N 0.37 1.41 -0.48 0.00 2.04 -0.86 0.49 117.51 120.48 1qez h ILE 3166Ca 0.48 -2.19 0.04 0.00 1.00 0.00 0.00 64.86 64.19 1qez h ILE 3166Cb 1.27 2.67 -0.04 0.00 -0.74 0.00 0.00 36.82 39.97 1qez h ILE 3166CO -0.18 0.64 0.25 0.11 0.00 0.00 0.00 178.15 178.98 1qez h LYS 3167N -0.06 0.49 -0.93 2.37 1.57 0.51 0.38 116.57 120.89 1qez h LYS 3167Ca -0.10 -0.03 0.23 0.00 -1.87 0.00 0.00 60.65 58.88 1qez h LYS 3167Cb 1.44 -0.11 -0.12 0.00 0.08 0.00 0.00 32.23 33.52 1qez h LYS 3167CO 0.14 0.32 0.45 0.00 -0.57 0.00 0.00 179.45 179.79 1qez h ARG 3168N 0.50 0.44 0.11 3.15 3.08 -1.05 -1.51 114.38 119.10 1qez h ARG 3168Ca 0.20 -0.03 -0.23 0.00 0.07 0.00 0.00 59.98 60.00 1qez h ARG 3168Cb 0.09 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.04 1qez h ARG 3168CO -0.13 0.29 -1.13 0.28 -1.07 0.00 0.00 179.97 178.21 1qez h VAL 3169N 0.45 1.22 0.00 2.04 2.07 -1.51 -3.46 116.25 117.07 1qez h VAL 3169Ca 0.58 -2.43 0.00 0.00 0.82 0.00 0.00 66.70 65.67 1qez h VAL 3169Cb 1.11 2.88 0.00 0.00 -1.52 0.00 0.00 31.29 33.76 1qez h VAL 3169CO -0.51 0.68 0.00 -0.24 0.02 0.00 0.00 177.57 177.52 1qez n SER 3170N -4.05 0.00 0.00 0.57 2.88 0.13 -5.12 113.62 108.02 1qez n SER 3170Ca -0.21 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.33 1qez n SER 3170Cb 0.84 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.30 1qez n SER 3170CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42